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[(p-Isopropylphenoxy)methyl]oxirane

HCID 102765
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Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
2210-72-2
Standard SMILES
CC(C)c1ccc(OCC2CO2)cc1
InChIKey
ZKNANXNFSTVHLT-UHFFFAOYSA-N
Molecular formula
C12H16O2
Average molar mass
192.25 g/mol
Monoisotopic mass
192.11502975

Names & identifiers

Preferred name
[(p-Isopropylphenoxy)methyl]oxirane
IUPAC
2-[(4-propan-2-ylphenoxy)methyl]oxirane
English name
[(p-isopropylphenoxy)methyl]oxirane
Molecular formula
C12H16O2
Molecular weight
192.25

Names & synonyms

2210-72-2[(p-Isopropylphenoxy)methyl]oxirane2-[4-(PROPAN-2-YL)PHENOXYMETHYL]OXIRANE2-((4-isopropylphenoxy)methyl)oxiraneMFCD021711672-{[4-(propan-2-yl)phenoxy]methyl}oxirane((p-Isopropylphenoxy)methyl)oxirane2-[(4-propan-2-ylphenoxy)methyl]oxirane2-[[4-(1-Methylethyl)phenoxy]methyl]oxiraneEINECS 218-643-22-[(4-Isopropylphenoxy)methyl]oxirane[(4-Isopropylphenoxy)methyl]oxirane
Show more names
di-tert-butyl benzene-1,4-dicarboperoxoate2-[4-(PROPAN-2-YL)PHENOXYMETHYL]OXIRANE(WXC06322)
2-(4-isopropyl-phenoxymethyl)-oxiraneOxirane, 2-[[4-(1-methylethyl)phenoxy]methyl]-SCHEMBL3143396SCHEMBL27603639DTXSID60944739AKOS000194292AKOS017283013AS-62362

Database identifiers

CAS
2210-72-2
PubChem CID
102765
DTXSID
DTXSID60944739
EC Number
218-643-2
Nikkaji
J299.166G

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
21.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
14
Formal charge
0
Complexity
171

Physicochemical properties

Boiling point
282.7 · 282.7±23.0 °C(Predicted)
Density
1.045 · 1.045±0.06 g/cm3(Predicted)
storage temp.
2 · Storage temp. 2-8°C
Appearance
Colorless to light yellow Liquid

Chemistry & industry

Suppliers10 total

Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
范德(北京)生物科技有限责任公司15911056312 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]

Related reactions

1 records
New reaction record
HRID 237774 reaction equation
HRID 237774As productuspto-grants-2014_02

Compound notes

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